SCHEMBL11946202

SCHEMBL11946202

CC1(COc2c(N3CCN(S(=O)(=O)Cc4ccc(-c5ccsc5)cc4)CC3)cnn(-c3cc(F)cc(F)c3)c2=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.35
▸ CYP17A1 P05093 2/20 0.33
▸ CYP21A2 P08686 2/20 0.33
▸ CYP11B1 P15538 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ NCOA2 Q15596 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ MMP13 P45452 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.31
▸ DCTPP1 Q9H773 1/20 0.31
▸ CYP19A1 P11511 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11946198 0.91 CYP17A1 (0.42) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11946203 0.89 MAPT (0.36) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11946199 0.88 CYP17A1 (0.34) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11944396 0.87 MAPT (0.38) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11946195 0.87 MAPT (0.38) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11945290 0.87 MAPT (0.38) MAPTCYP3A4POLBCYP2C19PPARG
SCHEMBL11945453 0.87 MAPT (0.45) MAPTCYP3A4POLBCYP2C19PPARG
SCHEMBL11945350 0.86 MAPT (0.39) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11946200 0.86 MAPT (0.35) MAPTCYP17A1CYP21A2CYP11B1CYP3A4
SCHEMBL11946396 0.86 MAPT (0.41) MAPTCYP17A1CYP21A2CYP11B1CYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors MAN2A1, GYS2, MANBA MAPT 2295/4885CYP17A1 744/4885CYP21A2 1120/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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